N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(p-tolyl)ethyl]-2-methyl-5-phenyl-thiazole-4-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-methylphenyl)ethyl]-2-methyl-5-phenyl-4-thiazolecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(p-tolyl)ethyl]-2-methyl-5-phenyl-thiazole-4-carboxamide Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)C2=C(SC(=N2)C)C3=CC=CC=C3)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(CNC(=O)C2=C(SC(=N2)C)C3=CC=CC=C3)N4CCCCCC4

InChI

InChI=1S/C26H31N3OS/c1-19-12-14-21(15-13-19)23(29-16-8-3-4-9-17-29)18-27-26(30)24-25(31-20(2)28-24)22-10-6-5-7-11-22/h5-7,10-15,23H,3-4,8-9,16-18H2,1-2H3,(H,27,30)